(5S)-5-aminopyrrolidin-2-one
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Basic information
- CAS
40759-90-8- Standard SMILES
N[C@@H]1CCC(=O)N1- InChIKey
URKYFRSLKUNMFG-VKHMYHEASA-N- Molecular formula
- C4H8N2O
- Average molar mass
- 100.12 g/mol
- Monoisotopic mass
- 100.06366288
Names & identifiers
- Preferred name
- (5S)-5-aminopyrrolidin-2-one
- IUPAC
- (5S)-5-aminopyrrolidin-2-one
- English name
- (5S)-5-Aminopyrrolidin-2-one
- Molecular formula
- C4H8N2O
- Molecular weight
- 100.12
Names & synonyms
AKOS006362968(5S)-5-Aminopyrrolidin-2-one2-Pyrrolidinone, 5-amino-, (S)- (9CI)
Database identifiers
- CAS
40759-90-8- PubChem CID
- 55290127
- Nikkaji
- J142.199I
Properties
Computed structural propertiesFilling in
- XLogP
- -1.2
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 7
- Formal charge
- 0
- Complexity
- 91.7
Physicochemical properties
- Boiling point
- 305.6 · 305.6±35.0 °C(Predicted)
- Density
- 1.127 · 1.127±0.06 g/cm3(Predicted)
- pka
- 15.57 · 15.57±0.40(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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